| SpectraBase Compound ID | EXMnLKOApkZ |
|---|---|
| InChI | InChI=1S/2C11H17N6O5PS/c2*1-21-23(20,24)16-6-5(2-18)22-11(8(6)19)17-4-15-7-9(12)13-3-14-10(7)17/h2*3-6,8,11,18-19H,2H2,1H3,(H2,12,13,14)(H2,16,20,24)/t2*5-,6-,8-,11-,23?/m00/s1 |
| InChIKey | SVNJNDLQLBRATA-HCBFHVRDSA-N |
| Mol Weight | 752.66 g/mol |
| Molecular Formula | C22H34N12O10P2S2 |
| Exact Mass | 752.143752 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5Q71FqKjd4J |
|---|---|
| Name | SVNJNDLQLBRATA-HCBFHVRDSA-N |
| Compound Number | 23 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H32N12O10P2S2 |
| InChI | InChI=1S/2C11H17N6O5PS/c2*1-21-23(20,24)16-6-5(2-18)22-11(8(6)19)17-4-15-7-9(12)13-3-14-10(7)17/h2*3-6,8,11,18-19H,2H2,1H3,(H2,12,13,14)(H2,16,20,24)/t2*5-,6-,8-,11-,23?/m00/s1 |
| InChIKey | SVNJNDLQLBRATA-HCBFHVRDSA-N |
| Literature Reference Author | M.MORR,L.ERNST |
| Literature Reference Citation | CHEM.BER.,111,2152(1978) |
| Literature Reference DOI | 10.1002/cber.19781110612 |
| Molecular Weight | 750.638 g/mol |
| Solvent | D2O,PD=8-10 |
| Source File Reference | UWCS8988 |